N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide

C15H13Cl2N3O2 — CID 39184820

IUPACN-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide
SMILESNCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc(Cl)c2)c1
InChIInChI=1S/C15H13Cl2N3O2/c16-10-3-1-2-9(6-10)15(22)20-13-7-11(4-5-12(13)17)19-14(21)8-18/h1-7H,8,18H2,(H,19,21)(H,20,22)
InChIKeyMDUZCCZJIJMULU-UHFFFAOYSA-N
MW338.19 g/mol
LogP3.14
Rot. Bonds4

About N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide

N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide (PubChem CID 39184820) has the molecular formula C15H13Cl2N3O2 and a molecular weight of 338.19 g/mol. Its IUPAC name is N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide.

Molecular Properties

Compound NameN-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide
PubChem CID39184820
Molecular FormulaC15H13Cl2N3O2
Molecular Weight338.19 g/mol
Exact Mass337.04
IUPAC NameN-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide
SMILESNCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc(Cl)c2)c1
InChIInChI=1S/C15H13Cl2N3O2/c16-10-3-1-2-9(6-10)15(22)20-13-7-11(4-5-12(13)17)19-14(21)8-18/h1-7H,8,18H2,(H,19,21)(H,20,22)
InChIKeyMDUZCCZJIJMULU-UHFFFAOYSA-N
XLogP3.14
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.19
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-methoxybenzamide
CID 39184782
N-[2-[(2-aminoacetyl)amino]phenyl]-3-chlorobenzamide
CID 39184246
N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide
CID 39184826
N-[4-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-methylbenzamide
CID 39186055
N-[4-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-fluorobenzamide
CID 39186063
N-[3-[(2-aminoacetyl)amino]-4-chlorophenyl]-2-phenylacetamide
CID 39184468
3-chloro-N-(2,4,5-trichlorophenyl)benzamide
CID 854431
N-[5-(3-aminopropanoylamino)-2-chlorophenyl]-4-methylbenzamide
CID 82034457
3-(3-aminoprop-1-ynyl)-N-(2,5-dichlorophenyl)benzamide
CID 60821048
3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981
3-chloro-N-[2-chloro-5-[[4-(1,1-dioxothiazetidin-2-yl)benzoyl]amino]phenyl]benzamide
CID 90130427
N-[3-[(2-aminoacetyl)amino]-4-chlorophenyl]-2-fluorobenzamide
CID 39184440

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide?
The IUPAC name of N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide (CID 39184820) is N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide.
What is the SMILES notation for N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide?
The canonical SMILES for N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide is NCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccc(Cl)c2)c1.
What is the InChIKey of N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide?
The InChIKey is MDUZCCZJIJMULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2N3O2/c16-10-3-1-2-9(6-10)15(22)20-13-7-11(4-5-12(13)17)19-14(21)8-18/h1-7H,8,18H2,(H,19,21)(H,20,22).
What are the key properties of N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide?
N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide has a molecular weight of 338.19 g/mol, XLogP of 3.14, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide is sourced from PubChem (CID 39184820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).